Basis Sets in Computational Chemistry

Language: English

Published by Springer International Publishing Mai 2021, 2021

3030672611 / 9783030672614

Series: Book 33 of 33 - Lecture Notes in Chemistry

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Seller: BuchWeltWeit Ludwig Meier e.K., Bergisch Gladbach, GermanyBuchWeltWeit Ludwig Meier e.K.

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This item is printed on demand - it takes 3-4 days longer - Neuware -This book addresses the construction and application of the major types of basis sets for computational chemistry calculations. In addition to a general introduction, it includes mathematical basics and a discussion of errors arising from incomplete or inappropriate basis sets. The different chapters introduce local orbitals and orbital localization as well as Slater-type orbitals and review basis sets for special applications, such as those for correlated methods, solid-state calculations, heavy atoms and time-dependent adaptable Gaussian bases for quantum dynamics simulations. This detailed review of the purpose of basis sets, their design, applications, possible problems and available solutions provides graduate students and beginning researchers with information not easily obtained from the available textbooks and offers valuable supporting material for any quantum chemistry or computational chemistry course at the graduate and/or undergraduate level. This book is also useful asa guide for researchers who are new to computational chemistry but are willing to extend their research tools by applying such methods. 264 pp. Englisch.…

Seller Inventory # 9783030672614

Title
Basis Sets in Computational Chemistry
Author
Eva Perlt
Publisher
Springer International Publishing Mai 2021
Publication year
2021
Condition
Neu
Binding
Buch
Language
English
ISBN 10
3030672611
ISBN 13
9783030672614
Item weight
613 grams
Dimensions
241x160x19 mm
Series
Book 33 of 33: Lecture Notes in Chemistry

BuchWeltWeit Ludwig Meier e.K.

Bergisch Gladbach, Germany

5-star seller

AbeBooks seller since January 11, 2012

Shipping rates from Germany to U.S.A.

Item5 to 15 business days5 to 15 business days
First itemUS$ 26.20US$ 26.20
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BuchWeltWeit Ludwig Meier e.K.

Germany